SCHEMBL2478261

SCHEMBL2478261

Cc1cc(N)c2ncccc2c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSMD14 O00487 1/20 0.62
COPS5 Q92905 1/20 0.62
CCR1 P32246 4/20 0.58
CCR8 P51685 4/20 0.58
CCR5 P51681 2/20 0.58
LMNA P02545 2/20 0.52
ALDH1A1 P00352 3/20 0.48
PRMT5 O14744 1/20 0.47
MCHR1 Q99705 1/20 0.47
SLC40A1 Q9NP59 3/20 0.47
KDM4E B2RXH2 2/20 0.45
MAPT P10636 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
GMNN O75496 1/20 0.45
TP53 P04637 1/20 0.45
HSP90AA1 P07900 1/20 0.45
MMP2 P08253 1/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2D6 P10635 1/20 0.45
MMP9 P14780 1/20 0.45

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL18434624 0.82 CCR1 (0.51) PSMD14COPS5CCR1CCR8CCR5
SCHEMBL7548538 0.80 KDM4E (0.52) PSMD14COPS5CCR1CCR8CCR5
SCHEMBL874272 0.80 PSMD14 (0.67) PSMD14COPS5CCR1CCR8CCR5
SCHEMBL2471617 0.78 SLC40A1 (0.47) PSMD14COPS5CCR1CCR8CCR5
SCHEMBL3803953 0.77 PSMD14 (0.50) PSMD14COPS5CCR1CCR8CCR5
SCHEMBL20176002 0.77 KMT2A (0.49) PSMD14COPS5CCR1CCR8CCR5
SCHEMBL2696188 0.77 PSMD14 (0.62) PSMD14COPS5CCR1CCR8CCR5
SCHEMBL3713624 0.77 PSMD14 (0.62) PSMD14COPS5CCR1CCR8CCR5
SCHEMBL1611156 0.77 NR4A2 (0.53) PSMD14COPS5CCR1CCR8CCR5
SCHEMBL5536434 0.77 PSMD14 (0.62) PSMD14COPS5CCR1CCR8CCR5

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 44 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240148744-A1 SULFONAMIDES AND THEIR USE FOR TREATMENT OF HELMINTHIC INFECTIONS AND DISEASES ZOETIS LLC 2024-05-09 US disclosed
EP-4291555-A1 SULFONAMIDES AND THEIR USE FOR TREATMENT OF HELMINTHIC INFECTIONS AND DISEASES Celgene Corporation (US) 2023-12-20 EP disclosed
CN-116806218-A Sulfonamide and its use for the treatment of parasitic helminth infections and diseases 新基公司 2023-09-26 CN disclosed
WO-2022173727-A1 SULFONAMIDES AND THEIR USE FOR TREATMENT OF HELMINTHIC INFECTIONS AND DISEASES CELGENE CORPORATION (US) 2022-08-18 WO disclosed
US-11396501-B2 Heteroaryl compounds as CXCR4 inhibitors, composition and method using the same CGENETECH (SUZHOU, CHINA) CO., LTD. (CN) 2022-07-26 US disclosed
US-20220081412-A1 QUINOLINYL-PYRAZINE-CARBOXAMIDE COMPOUNDS AND USES THEREOF THE REGENTS OF THE UNIVERSITY OF MICHIGAN 2022-03-17 US disclosed
EP-3687540-A1 HETEROARYL COMPOUNDS AS CXCR4 INHIBITORS, COMPOSITION AND METHOD USING THE SAME CGeneTech (Suzhou, China) Co., Ltd. (CN) 2020-08-05 EP disclosed
US-20200239439-A1 HETEROARYL COMPOUNDS AS CXCR4 INHIBITORS, COMPOSITION AND METHOD USING THE SAME Suzhou Yunxuan Yiyao Keji Youxian Gongsi (CN) 2020-07-30 US disclosed
US-20200239439-A1 HETEROARYL COMPOUNDS AS CXCR4 INHIBITORS, COMPOSITION AND METHOD USING THE SAME Suzhou Yunxuan Yiyao Keji Youxian Gongsi (CN) 2020-07-30 US disclosed
WO-2020132459-A1 QUINOLINYL-PYRAZINE-CARBOXAMIDE COMPOUNDS AND USES THEREOF THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2020-06-25 WO disclosed
EP-2196466-A1 Triple substituted phenanthroline derivatives for the treatment of neurodegenerative or heamatological diseases or conditions NOSCIRA, S.A. (ES) 2010-06-16 EP disclosed
US-6939969-B2 Tri-and bidentate amido ligands prepared by palladium0 coupling and metallation thereof to form metal-amido catalysts CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2005-09-06 US disclosed
US-20030032808-A1 Tri-and bidentate amido ligands prepared by palladium0 coupling and metallation threreof to form metal-amido catalysts CALIFORNIA INSTITUTE OF TECHNOLOGY 2003-02-13 US disclosed
WO-2002079207-A2 TRI-AND BIDENTATE AMIDO LIGANDS PREPARED BY PALLADIUM0 COUPLING AND METALLATION THEREOF TO FORM METAL-AMIDO CATALYSTS CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2002-10-10 WO disclosed
US-5075488-A Fungicides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1991-12-24 US disclosed
EP-0128006-B1 A SOIL-DISEASE-CONTROLLING AGENT SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1991-09-18 EP disclosed
US-4709052-A FUNGICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1987-11-24 US disclosed
EP-0128006-A2 A soil-disease-controlling agent SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1984-12-12 EP disclosed
US-4209419-A Certain sulfonamidoquinolines, metal complexes thereof, and solutions containing such sulfonamidoquinolines and metal complexes HENKEL CORPORATION (US) 1980-06-24 US disclosed
US-4100163-A Substituted 8-sulfonamidoquinolines GENERAL MILLS CHEMICALS, INC. (US) 1978-07-11 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (5 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11396501-B2 Heteroaryl compounds as CXCR4 inhibitors, composition and method using the same CXCR4, CXCL12, CXCR1 PSMD14 4783/4885COPS5 3151/4885CCR1 14/4885
US-20220081412-A1 QUINOLINYL-PYRAZINE-CARBOXAMIDE COMPOUNDS AND USES THEREOF HMGB3, HCCS, ACACA PSMD14 3179/4885COPS5 2774/4885CCR1 477/4885
US-20030032808-A1 Tri-and bidentate amido ligands prepared by palladium0 coupling and metallation threreof to form metal-amido catalysts PUF60, PDCD10, HDAC10 PSMD14 3960/4885COPS5 3254/4885CCR1 4461/4885
US-20200239439-A1 HETEROARYL COMPOUNDS AS CXCR4 INHIBITORS, COMPOSITION AND METHOD USING THE SAME CXCR4, CXCL12, CXCR1 PSMD14 4783/4885COPS5 3151/4885CCR1 14/4885
US-20240148744-A1 SULFONAMIDES AND THEIR USE FOR TREATMENT OF HELMINTHIC INFECTIONS AND DISEASES ARSA, MRPS2, SULT2A1 PSMD14 2730/4885COPS5 2122/4885CCR1 1715/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.